SCHEMBL8607795

SCHEMBL8607795

CC(=O)Sc1nccn1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.50
ALOX15 P16050 1/20 0.50
ALDH1A1 P00352 4/20 0.48
POLB P06746 4/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
KMT2A Q03164 3/20 0.45
HPGD P15428 2/20 0.45
TP53 P04637 2/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
ALOX12 P18054 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ALPL P05186 1/20 0.43
ALPG P10696 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 1/20 0.42
LMNA P02545 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14624712 0.76 ALDH1A1 (0.60) ALDH1A1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL28198306 0.76 SMN1; SMN2 (0.37) ALDH1A1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL28127725 0.74
SCHEMBL2980873 0.74
SCHEMBL8938457 0.73 LPO (0.48) GLAALOX15ALDH1A1POLBNPC1
SCHEMBL9805593 0.73 ALDH1A1 (0.61) ALDH1A1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL28384357 0.73 LMNA (0.43) GLAALOX15ALDH1A1NPC1RAB9A
SCHEMBL10913815 0.72 LPO (0.43) GLAALOX15ALDH1A1POLBNPC1
SCHEMBL7258739 0.72 ALDH1A1 (0.39) GLAALOX15ALDH1A1POLBNPC1
SCHEMBL3764555 0.72 RAB9A (0.60) ALDH1A1POLBNPC1RAB9ASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107522661-B Preparation method of 2-mercapto-1-alkyl imidazole 浦拉司科技(上海)有限责任公司 2020-01-07 CN disclosed
CN-107522661-A A kind of preparation method of the alkyl imidazole of 2 sulfydryl 1 浦拉司科技(上海)有限责任公司 2017-12-29 CN disclosed
US-5747513-A HYPOTENSIVE AGENTS, HEART FAILURE AND CEREBROVASCULAR INSUFFICIENCY ZAMBON GROUP, S.P.A. (IT) 1998-05-05 US disclosed